ethyl 2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanamido]-5-phenylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanamido]-5-phenylthiophene-3-carboxylate
ethyl 2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanamido]-5-phenylthiophene-3-carboxylate
Compound characteristics
Compound ID: | 3643-3004 |
Compound Name: | ethyl 2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanamido]-5-phenylthiophene-3-carboxylate |
Molecular Weight: | 476.55 |
Molecular Formula: | C26 H24 N2 O5 S |
Smiles: | CCOC(c1cc(c2ccccc2)sc1NC(C(C(C)C)N1C(c2ccccc2C1=O)=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.7899 |
logD: | 5.7623 |
logSw: | -5.4716 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.092 |
InChI Key: | IPOSSMZUGVUHDL-NRFANRHFSA-N |